methyl (1R,2S)-2-bromanyl-1-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,2S)-2-bromanyl-1-oxidanyl-cyclohexane-1-carboxylate Openeye Name: methyl (1R,2S)-2-bromo-1-hydroxy-cyclohexanecarboxylate CAS Name: (1R,2S)-2-bromo-1-hydroxy-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2S)-2-bromo-1-hydroxycyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-bromo-1-hydroxy-cyclohexanecarboxylic acid methyl ester Formula: C8H13BrO3 MolecularWeight: 237.09102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1Br)O

Isomeric SMILES

COC(=O)[C@@]1(CCCC[C@@H]1Br)O

InChI

InChI=1S/C8H13BrO3/c1-12-7(10)8(11)5-3-2-4-6(8)9/h6,11H,2-5H2,1H3/t6-,8-/m0/s1